6-azanyl-1-(2-methoxyethyl)-5-[2-[4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)piperazin-4-ium-1-yl]ethanoyl]pyrimidine-2,4-dione

Systemtic Name: 6-azanyl-1-(2-methoxyethyl)-5-[2-[4-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)piperazin-4-ium-1-yl]ethanoyl]pyrimidine-2,4-dione Openeye Name: 6-amino-1-(2-methoxyethyl)-5-[2-[4-(2-oxo-2-pyrrolidin-1-yl-ethyl)piperazin-4-ium-1-yl]acetyl]pyrimidine-2,4-dione CAS Name: 6-amino-1-(2-methoxyethyl)-5-[1-oxo-2-[4-[2-oxo-2-(1-pyrrolidinyl)ethyl]-1-piperazin-4-iumyl]ethyl]pyrimidine-2,4-dione IUPAC Name: 6-amino-1-(2-methoxyethyl)-5-[2-[4-(2-oxo-2-pyrrolidin-1-ylethyl)piperazin-4-ium-1-yl]acetyl]pyrimidine-2,4-dione Traditional Name: 6-amino-5-[2-[4-(2-keto-2-pyrrolidino-ethyl)piperazin-4-ium-1-yl]acetyl]-1-(2-methoxyethyl)pyrimidine-2,4-quinone Formula: C19H31N6O5+ MolecularWeight: 423.48664

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Descriptors Computed from Structure

Canonical SMILES:

COCCN1C(=C(C(=O)NC1=O)C(=O)CN2CC[NH+](CC2)CC(=O)N3CCCC3)N

Isomeric SMILES

COCCN1C(=C(C(=O)NC1=O)C(=O)CN2CC[NH+](CC2)CC(=O)N3CCCC3)N

InChI

InChI=1S/C19H30N6O5/c1-30-11-10-25-17(20)16(18(28)21-19(25)29)14(26)12-22-6-8-23(9-7-22)13-15(27)24-4-2-3-5-24/h2-13,20H2,1H3,(H,21,28,29)/p+1